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1977535-33-3

1977535-33-3 | (3-nitrophenyl-1,2,3,4,5,6-13C6)hydrazine,monohydrochloride

CAS No: 1977535-33-3 Catalog No: AG01EPLA MDL No:

Product Description

Catalog Number:
AG01EPLA
Chemical Name:
(3-nitrophenyl-1,2,3,4,5,6-13C6)hydrazine,monohydrochloride
CAS Number:
1977535-33-3
Molecular Formula:
C6H8ClN3O2
Molecular Weight:
195.5555
IUPAC Name:
(3-nitro(1,2,3,4,5,6-13C6)cyclohexa-1,3,5-trien-1-yl)hydrazine;hydrochloride
InChI:
InChI=1S/C6H7N3O2.ClH/c7-8-5-2-1-3-6(4-5)9(10)11;/h1-4,8H,7H2;1H/i1+1,2+1,3+1,4+1,5+1,6+1;
InChI Key:
BKOYKMLGFFASBG-BVNCJLROSA-N
SMILES:
NN[13c]1[13cH][13cH][13cH][13c]([13cH]1)[N+](=O)[O-].Cl

Properties

Complexity:
145  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
195.051g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
6  
Molecular Weight:
195.553g/mol
Monoisotopic Mass:
195.051g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
83.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0

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